################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15551 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15551 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 LEU H H 1 8.492 . . 1 . . . . 151 LEU H . 15551 1 2 . 1 1 3 3 LEU N N 15 121.589 . . 1 . . . . 151 LEU N . 15551 1 3 . 1 1 4 4 GLY H H 1 8.042 . . 1 . . . . 152 GLY H . 15551 1 4 . 1 1 4 4 GLY N N 15 108.377 . . 1 . . . . 152 GLY N . 15551 1 5 . 1 1 5 5 SER H H 1 8.072 . . 1 . . . . 153 SER H . 15551 1 6 . 1 1 5 5 SER N N 15 115.642 . . 1 . . . . 153 SER N . 15551 1 7 . 1 1 6 6 GLN H H 1 7.835 . . 1 . . . . 154 GLN H . 15551 1 8 . 1 1 6 6 GLN HE21 H 1 7.37 . . 2 . . . . 154 GLN HE21 . 15551 1 9 . 1 1 6 6 GLN HE22 H 1 6.712 . . 2 . . . . 154 GLN HE22 . 15551 1 10 . 1 1 6 6 GLN N N 15 119.418 . . 1 . . . . 154 GLN N . 15551 1 11 . 1 1 6 6 GLN NE2 N 15 110.345 . . 1 . . . . 154 GLN NE2 . 15551 1 12 . 1 1 7 7 PHE H H 1 8.692 . . 1 . . . . 155 PHE H . 15551 1 13 . 1 1 7 7 PHE N N 15 119.875 . . 1 . . . . 155 PHE N . 15551 1 14 . 1 1 8 8 TRP H H 1 9.483 . . 1 . . . . 156 TRP H . 15551 1 15 . 1 1 8 8 TRP HE1 H 1 10.025 . . 1 . . . . 156 TRP HE1 . 15551 1 16 . 1 1 8 8 TRP N N 15 126.666 . . 1 . . . . 156 TRP N . 15551 1 17 . 1 1 8 8 TRP NE1 N 15 128.149 . . 1 . . . . 156 TRP NE1 . 15551 1 18 . 1 1 9 9 VAL H H 1 9.333 . . 1 . . . . 157 VAL H . 15551 1 19 . 1 1 9 9 VAL N N 15 118.931 . . 1 . . . . 157 VAL N . 15551 1 20 . 1 1 10 10 THR H H 1 8.037 . . 1 . . . . 158 THR H . 15551 1 21 . 1 1 10 10 THR N N 15 115.313 . . 1 . . . . 158 THR N . 15551 1 22 . 1 1 11 11 VAL H H 1 9.027 . . 1 . . . . 159 VAL H . 15551 1 23 . 1 1 11 11 VAL N N 15 128.198 . . 1 . . . . 159 VAL N . 15551 1 24 . 1 1 12 12 GLN H H 1 8.459 . . 1 . . . . 160 GLN H . 15551 1 25 . 1 1 12 12 GLN HE21 H 1 7.194 . . 2 . . . . 160 GLN HE21 . 15551 1 26 . 1 1 12 12 GLN HE22 H 1 6.816 . . 2 . . . . 160 GLN HE22 . 15551 1 27 . 1 1 12 12 GLN N N 15 128.255 . . 1 . . . . 160 GLN N . 15551 1 28 . 1 1 12 12 GLN NE2 N 15 111.436 . . 1 . . . . 160 GLN NE2 . 15551 1 29 . 1 1 13 13 ARG H H 1 8.644 . . 1 . . . . 161 ARG H . 15551 1 30 . 1 1 13 13 ARG N N 15 124.998 . . 1 . . . . 161 ARG N . 15551 1 31 . 1 1 14 14 THR H H 1 7.089 . . 1 . . . . 162 THR H . 15551 1 32 . 1 1 14 14 THR N N 15 115.721 . . 1 . . . . 162 THR N . 15551 1 33 . 1 1 15 15 GLU H H 1 9.139 . . 1 . . . . 163 GLU H . 15551 1 34 . 1 1 15 15 GLU N N 15 122.806 . . 1 . . . . 163 GLU N . 15551 1 35 . 1 1 16 16 ALA H H 1 8.336 . . 1 . . . . 164 ALA H . 15551 1 36 . 1 1 16 16 ALA N N 15 120.99 . . 1 . . . . 164 ALA N . 15551 1 37 . 1 1 17 17 ALA H H 1 7.079 . . 1 . . . . 165 ALA H . 15551 1 38 . 1 1 17 17 ALA N N 15 119.335 . . 1 . . . . 165 ALA N . 15551 1 39 . 1 1 18 18 GLU H H 1 8.189 . . 1 . . . . 166 GLU H . 15551 1 40 . 1 1 18 18 GLU N N 15 117.389 . . 1 . . . . 166 GLU N . 15551 1 41 . 1 1 19 19 ARG H H 1 8.34 . . 1 . . . . 167 ARG H . 15551 1 42 . 1 1 19 19 ARG N N 15 122.587 . . 1 . . . . 167 ARG N . 15551 1 43 . 1 1 20 20 CYS H H 1 7.664 . . 1 . . . . 168 CYS H . 15551 1 44 . 1 1 20 20 CYS N N 15 113.427 . . 1 . . . . 168 CYS N . 15551 1 45 . 1 1 21 21 GLY H H 1 7.887 . . 1 . . . . 169 GLY H . 15551 1 46 . 1 1 21 21 GLY N N 15 109.315 . . 1 . . . . 169 GLY N . 15551 1 47 . 1 1 22 22 LEU H H 1 8.276 . . 1 . . . . 170 LEU H . 15551 1 48 . 1 1 22 22 LEU N N 15 118.091 . . 1 . . . . 170 LEU N . 15551 1 49 . 1 1 23 23 HIS H H 1 8.912 . . 1 . . . . 171 HIS H . 15551 1 50 . 1 1 23 23 HIS N N 15 119.97 . . 1 . . . . 171 HIS N . 15551 1 51 . 1 1 24 24 GLY H H 1 9.33 . . 1 . . . . 172 GLY H . 15551 1 52 . 1 1 24 24 GLY N N 15 113.477 . . 1 . . . . 172 GLY N . 15551 1 53 . 1 1 25 25 SER H H 1 8.189 . . 1 . . . . 173 SER H . 15551 1 54 . 1 1 25 25 SER N N 15 117.002 . . 1 . . . . 173 SER N . 15551 1 55 . 1 1 26 26 TYR H H 1 8.979 . . 1 . . . . 174 TYR H . 15551 1 56 . 1 1 26 26 TYR N N 15 120.459 . . 1 . . . . 174 TYR N . 15551 1 57 . 1 1 27 27 VAL H H 1 8.282 . . 1 . . . . 175 VAL H . 15551 1 58 . 1 1 27 27 VAL N N 15 118.409 . . 1 . . . . 175 VAL N . 15551 1 59 . 1 1 28 28 LEU H H 1 9.418 . . 1 . . . . 176 LEU H . 15551 1 60 . 1 1 28 28 LEU N N 15 129.254 . . 1 . . . . 176 LEU N . 15551 1 61 . 1 1 29 29 ARG H H 1 9.841 . . 1 . . . . 177 ARG H . 15551 1 62 . 1 1 29 29 ARG N N 15 128.619 . . 1 . . . . 177 ARG N . 15551 1 63 . 1 1 30 30 VAL H H 1 8.926 . . 1 . . . . 178 VAL H . 15551 1 64 . 1 1 30 30 VAL N N 15 128.836 . . 1 . . . . 178 VAL N . 15551 1 65 . 1 1 31 31 GLU H H 1 8.215 . . 1 . . . . 179 GLU H . 15551 1 66 . 1 1 31 31 GLU N N 15 125.568 . . 1 . . . . 179 GLU N . 15551 1 67 . 1 1 32 32 ALA H H 1 8.725 . . 1 . . . . 180 ALA H . 15551 1 68 . 1 1 32 32 ALA N N 15 121.807 . . 1 . . . . 180 ALA N . 15551 1 69 . 1 1 33 33 GLU H H 1 8.377 . . 1 . . . . 181 GLU H . 15551 1 70 . 1 1 33 33 GLU N N 15 108.665 . . 1 . . . . 181 GLU N . 15551 1 71 . 1 1 34 34 ARG H H 1 6.683 . . 1 . . . . 182 ARG H . 15551 1 72 . 1 1 34 34 ARG N N 15 116.878 . . 1 . . . . 182 ARG N . 15551 1 73 . 1 1 35 35 LEU H H 1 7.655 . . 1 . . . . 183 LEU H . 15551 1 74 . 1 1 35 35 LEU N N 15 117.403 . . 1 . . . . 183 LEU N . 15551 1 75 . 1 1 36 36 THR H H 1 9.142 . . 1 . . . . 184 THR H . 15551 1 76 . 1 1 36 36 THR N N 15 119.716 . . 1 . . . . 184 THR N . 15551 1 77 . 1 1 37 37 LEU H H 1 9.352 . . 1 . . . . 185 LEU H . 15551 1 78 . 1 1 37 37 LEU N N 15 129.724 . . 1 . . . . 185 LEU N . 15551 1 79 . 1 1 38 38 LEU H H 1 9.996 . . 1 . . . . 186 LEU H . 15551 1 80 . 1 1 38 38 LEU N N 15 127.095 . . 1 . . . . 186 LEU N . 15551 1 81 . 1 1 39 39 THR H H 1 8.689 . . 1 . . . . 187 THR H . 15551 1 82 . 1 1 39 39 THR N N 15 113.589 . . 1 . . . . 187 THR N . 15551 1 83 . 1 1 40 40 VAL H H 1 8.103 . . 1 . . . . 188 VAL H . 15551 1 84 . 1 1 40 40 VAL N N 15 122.067 . . 1 . . . . 188 VAL N . 15551 1 85 . 1 1 41 41 GLY H H 1 8.842 . . 1 . . . . 189 GLY H . 15551 1 86 . 1 1 41 41 GLY N N 15 115.287 . . 1 . . . . 189 GLY N . 15551 1 87 . 1 1 42 42 ALA H H 1 8.731 . . 1 . . . . 190 ALA H . 15551 1 88 . 1 1 42 42 ALA N N 15 125.713 . . 1 . . . . 190 ALA N . 15551 1 89 . 1 1 43 43 GLN H H 1 8.368 . . 1 . . . . 191 GLN H . 15551 1 90 . 1 1 43 43 GLN HE21 H 1 7.565 . . 2 . . . . 191 GLN HE21 . 15551 1 91 . 1 1 43 43 GLN HE22 H 1 6.882 . . 2 . . . . 191 GLN HE22 . 15551 1 92 . 1 1 43 43 GLN N N 15 114.847 . . 1 . . . . 191 GLN N . 15551 1 93 . 1 1 43 43 GLN NE2 N 15 112.453 . . 1 . . . . 191 GLN NE2 . 15551 1 94 . 1 1 44 44 SER H H 1 8.271 . . 1 . . . . 192 SER H . 15551 1 95 . 1 1 44 44 SER N N 15 113.997 . . 1 . . . . 192 SER N . 15551 1 96 . 1 1 45 45 GLN H H 1 8.384 . . 1 . . . . 193 GLN H . 15551 1 97 . 1 1 45 45 GLN HE21 H 1 7.488 . . 2 . . . . 193 GLN HE21 . 15551 1 98 . 1 1 45 45 GLN HE22 H 1 6.874 . . 2 . . . . 193 GLN HE22 . 15551 1 99 . 1 1 45 45 GLN N N 15 117.051 . . 1 . . . . 193 GLN N . 15551 1 100 . 1 1 45 45 GLN NE2 N 15 112.875 . . 1 . . . . 193 GLN NE2 . 15551 1 101 . 1 1 46 46 ILE H H 1 8.01 . . 1 . . . . 194 ILE H . 15551 1 102 . 1 1 46 46 ILE N N 15 119.181 . . 1 . . . . 194 ILE N . 15551 1 103 . 1 1 47 47 LEU H H 1 8.396 . . 1 . . . . 195 LEU H . 15551 1 104 . 1 1 47 47 LEU N N 15 125.735 . . 1 . . . . 195 LEU N . 15551 1 105 . 1 1 50 50 LEU H H 1 9.334 . . 1 . . . . 198 LEU H . 15551 1 106 . 1 1 50 50 LEU N N 15 125.335 . . 1 . . . . 198 LEU N . 15551 1 107 . 1 1 51 51 LEU H H 1 7.17 . . 1 . . . . 199 LEU H . 15551 1 108 . 1 1 51 51 LEU N N 15 117.312 . . 1 . . . . 199 LEU N . 15551 1 109 . 1 1 52 52 SER H H 1 7.48 . . 1 . . . . 200 SER H . 15551 1 110 . 1 1 52 52 SER N N 15 112.636 . . 1 . . . . 200 SER N . 15551 1 111 . 1 1 53 53 TRP H H 1 9.496 . . 1 . . . . 201 TRP H . 15551 1 112 . 1 1 53 53 TRP HE1 H 1 9.28 . . 1 . . . . 201 TRP HE1 . 15551 1 113 . 1 1 53 53 TRP N N 15 123.482 . . 1 . . . . 201 TRP N . 15551 1 114 . 1 1 53 53 TRP NE1 N 15 127.434 . . 1 . . . . 201 TRP NE1 . 15551 1 115 . 1 1 55 55 TYR H H 1 7.508 . . 1 . . . . 203 TYR H . 15551 1 116 . 1 1 55 55 TYR N N 15 123.79 . . 1 . . . . 203 TYR N . 15551 1 117 . 1 1 56 56 THR H H 1 8.04 . . 1 . . . . 204 THR H . 15551 1 118 . 1 1 56 56 THR N N 15 106.758 . . 1 . . . . 204 THR N . 15551 1 119 . 1 1 57 57 LEU H H 1 7.558 . . 1 . . . . 205 LEU H . 15551 1 120 . 1 1 57 57 LEU N N 15 118.458 . . 1 . . . . 205 LEU N . 15551 1 121 . 1 1 58 58 LEU H H 1 7.503 . . 1 . . . . 206 LEU H . 15551 1 122 . 1 1 58 58 LEU N N 15 119.642 . . 1 . . . . 206 LEU N . 15551 1 123 . 1 1 59 59 ARG H H 1 9.093 . . 1 . . . . 207 ARG H . 15551 1 124 . 1 1 59 59 ARG N N 15 121.191 . . 1 . . . . 207 ARG N . 15551 1 125 . 1 1 60 60 ARG H H 1 7.541 . . 1 . . . . 208 ARG H . 15551 1 126 . 1 1 60 60 ARG N N 15 111.778 . . 1 . . . . 208 ARG N . 15551 1 127 . 1 1 61 61 TYR H H 1 7.843 . . 1 . . . . 209 TYR H . 15551 1 128 . 1 1 61 61 TYR N N 15 115.834 . . 1 . . . . 209 TYR N . 15551 1 129 . 1 1 62 62 GLY H H 1 8.972 . . 1 . . . . 210 GLY H . 15551 1 130 . 1 1 62 62 GLY N N 15 107.087 . . 1 . . . . 210 GLY N . 15551 1 131 . 1 1 63 63 ARG H H 1 8.239 . . 1 . . . . 211 ARG H . 15551 1 132 . 1 1 63 63 ARG N N 15 115.563 . . 1 . . . . 211 ARG N . 15551 1 133 . 1 1 64 64 ASP H H 1 8.883 . . 1 . . . . 212 ASP H . 15551 1 134 . 1 1 64 64 ASP N N 15 122.647 . . 1 . . . . 212 ASP N . 15551 1 135 . 1 1 65 65 LYS H H 1 8.143 . . 1 . . . . 213 LYS H . 15551 1 136 . 1 1 65 65 LYS N N 15 115.247 . . 1 . . . . 213 LYS N . 15551 1 137 . 1 1 66 66 VAL H H 1 8.929 . . 1 . . . . 214 VAL H . 15551 1 138 . 1 1 66 66 VAL N N 15 112.24 . . 1 . . . . 214 VAL N . 15551 1 139 . 1 1 67 67 MET H H 1 8.381 . . 1 . . . . 215 MET H . 15551 1 140 . 1 1 67 67 MET N N 15 120.814 . . 1 . . . . 215 MET N . 15551 1 141 . 1 1 68 68 PHE H H 1 8.848 . . 1 . . . . 216 PHE H . 15551 1 142 . 1 1 68 68 PHE N N 15 118.786 . . 1 . . . . 216 PHE N . 15551 1 143 . 1 1 69 69 SER H H 1 8.316 . . 1 . . . . 217 SER H . 15551 1 144 . 1 1 69 69 SER N N 15 121.782 . . 1 . . . . 217 SER N . 15551 1 145 . 1 1 70 70 PHE H H 1 8.624 . . 1 . . . . 218 PHE H . 15551 1 146 . 1 1 70 70 PHE N N 15 118.008 . . 1 . . . . 218 PHE N . 15551 1 147 . 1 1 71 71 GLU H H 1 8.478 . . 1 . . . . 219 GLU H . 15551 1 148 . 1 1 71 71 GLU N N 15 119.192 . . 1 . . . . 219 GLU N . 15551 1 149 . 1 1 72 72 ALA H H 1 9.743 . . 1 . . . . 220 ALA H . 15551 1 150 . 1 1 72 72 ALA N N 15 131.141 . . 1 . . . . 220 ALA N . 15551 1 151 . 1 1 73 73 GLY H H 1 8.365 . . 1 . . . . 221 GLY H . 15551 1 152 . 1 1 73 73 GLY N N 15 109.35 . . 1 . . . . 221 GLY N . 15551 1 153 . 1 1 74 74 ARG H H 1 8.959 . . 1 . . . . 222 ARG H . 15551 1 154 . 1 1 74 74 ARG N N 15 117.108 . . 1 . . . . 222 ARG N . 15551 1 155 . 1 1 75 75 ARG H H 1 8.576 . . 1 . . . . 223 ARG H . 15551 1 156 . 1 1 75 75 ARG N N 15 115.506 . . 1 . . . . 223 ARG N . 15551 1 157 . 1 1 76 76 CYS H H 1 7.603 . . 1 . . . . 224 CYS H . 15551 1 158 . 1 1 76 76 CYS N N 15 118.443 . . 1 . . . . 224 CYS N . 15551 1 159 . 1 1 78 78 SER H H 1 8.148 . . 1 . . . . 226 SER H . 15551 1 160 . 1 1 78 78 SER N N 15 108.978 . . 1 . . . . 226 SER N . 15551 1 161 . 1 1 79 79 GLY H H 1 8.123 . . 1 . . . . 227 GLY H . 15551 1 162 . 1 1 79 79 GLY N N 15 111.488 . . 1 . . . . 227 GLY N . 15551 1 163 . 1 1 81 81 GLY H H 1 7.988 . . 1 . . . . 229 GLY H . 15551 1 164 . 1 1 81 81 GLY N N 15 104.962 . . 1 . . . . 229 GLY N . 15551 1 165 . 1 1 82 82 THR H H 1 8.064 . . 1 . . . . 230 THR H . 15551 1 166 . 1 1 82 82 THR N N 15 116.463 . . 1 . . . . 230 THR N . 15551 1 167 . 1 1 83 83 PHE H H 1 8.811 . . 1 . . . . 231 PHE H . 15551 1 168 . 1 1 83 83 PHE N N 15 128.195 . . 1 . . . . 231 PHE N . 15551 1 169 . 1 1 84 84 THR H H 1 9.423 . . 1 . . . . 232 THR H . 15551 1 170 . 1 1 84 84 THR N N 15 120.304 . . 1 . . . . 232 THR N . 15551 1 171 . 1 1 85 85 PHE H H 1 9.375 . . 1 . . . . 233 PHE H . 15551 1 172 . 1 1 85 85 PHE N N 15 123.584 . . 1 . . . . 233 PHE N . 15551 1 173 . 1 1 86 86 GLN H H 1 9.747 . . 1 . . . . 234 GLN H . 15551 1 174 . 1 1 86 86 GLN HE21 H 1 8.18 . . 2 . . . . 234 GLN HE21 . 15551 1 175 . 1 1 86 86 GLN HE22 H 1 7.388 . . 2 . . . . 234 GLN HE22 . 15551 1 176 . 1 1 86 86 GLN N N 15 123.979 . . 1 . . . . 234 GLN N . 15551 1 177 . 1 1 86 86 GLN NE2 N 15 113.915 . . 1 . . . . 234 GLN NE2 . 15551 1 178 . 1 1 87 87 THR H H 1 8.419 . . 1 . . . . 235 THR H . 15551 1 179 . 1 1 87 87 THR N N 15 122.015 . . 1 . . . . 235 THR N . 15551 1 180 . 1 1 88 88 ALA H H 1 9.092 . . 1 . . . . 236 ALA H . 15551 1 181 . 1 1 88 88 ALA N N 15 129.832 . . 1 . . . . 236 ALA N . 15551 1 182 . 1 1 89 89 GLN H H 1 9.529 . . 1 . . . . 237 GLN H . 15551 1 183 . 1 1 89 89 GLN NE2 N 15 110.727 . . 1 . . . . 237 GLN HE21 . 15551 1 184 . 1 1 89 89 GLN N N 15 120.86 . . 1 . . . . 237 GLN N . 15551 1 185 . 1 1 90 90 GLY H H 1 9.169 . . 1 . . . . 238 GLY H . 15551 1 186 . 1 1 90 90 GLY N N 15 111.664 . . 1 . . . . 238 GLY N . 15551 1 187 . 1 1 91 91 ASN H H 1 9.109 . . 1 . . . . 239 ASN H . 15551 1 188 . 1 1 91 91 ASN HD21 H 1 7.885 . . 2 . . . . 239 ASN HD21 . 15551 1 189 . 1 1 91 91 ASN HD22 H 1 7.01 . . 2 . . . . 239 ASN HD22 . 15551 1 190 . 1 1 91 91 ASN N N 15 118.781 . . 1 . . . . 239 ASN N . 15551 1 191 . 1 1 91 91 ASN ND2 N 15 114.618 . . 1 . . . . 239 ASN ND2 . 15551 1 192 . 1 1 92 92 ASP H H 1 7.667 . . 1 . . . . 240 ASP H . 15551 1 193 . 1 1 92 92 ASP N N 15 120.615 . . 1 . . . . 240 ASP N . 15551 1 194 . 1 1 93 93 ILE H H 1 7.804 . . 1 . . . . 241 ILE H . 15551 1 195 . 1 1 93 93 ILE N N 15 121.036 . . 1 . . . . 241 ILE N . 15551 1 196 . 1 1 94 94 PHE H H 1 8.307 . . 1 . . . . 242 PHE H . 15551 1 197 . 1 1 94 94 PHE N N 15 118.669 . . 1 . . . . 242 PHE N . 15551 1 198 . 1 1 95 95 GLN H H 1 8.492 . . 1 . . . . 243 GLN H . 15551 1 199 . 1 1 95 95 GLN HE21 H 1 7.41 . . 2 . . . . 243 GLN HE21 . 15551 1 200 . 1 1 95 95 GLN HE22 H 1 6.991 . . 2 . . . . 243 GLN HE22 . 15551 1 201 . 1 1 95 95 GLN N N 15 116.219 . . 1 . . . . 243 GLN N . 15551 1 202 . 1 1 95 95 GLN NE2 N 15 111.951 . . 1 . . . . 243 GLN NE2 . 15551 1 203 . 1 1 96 96 ALA H H 1 7.891 . . 1 . . . . 244 ALA H . 15551 1 204 . 1 1 96 96 ALA N N 15 123.735 . . 1 . . . . 244 ALA N . 15551 1 205 . 1 1 97 97 VAL H H 1 8.368 . . 1 . . . . 245 VAL H . 15551 1 206 . 1 1 97 97 VAL N N 15 122.577 . . 1 . . . . 245 VAL N . 15551 1 207 . 1 1 98 98 GLU H H 1 8.341 . . 1 . . . . 246 GLU H . 15551 1 208 . 1 1 98 98 GLU N N 15 118.601 . . 1 . . . . 246 GLU N . 15551 1 209 . 1 1 99 99 THR H H 1 8.166 . . 1 . . . . 247 THR H . 15551 1 210 . 1 1 99 99 THR N N 15 115.438 . . 1 . . . . 247 THR N . 15551 1 211 . 1 1 100 100 ALA H H 1 7.705 . . 1 . . . . 248 ALA H . 15551 1 212 . 1 1 100 100 ALA N N 15 125.015 . . 1 . . . . 248 ALA N . 15551 1 213 . 1 1 101 101 ILE H H 1 8.387 . . 1 . . . . 249 ILE H . 15551 1 214 . 1 1 101 101 ILE N N 15 119.585 . . 1 . . . . 249 ILE N . 15551 1 215 . 1 1 102 102 HIS H H 1 8.114 . . 1 . . . . 250 HIS H . 15551 1 216 . 1 1 102 102 HIS N N 15 117.697 . . 1 . . . . 250 HIS N . 15551 1 217 . 1 1 103 103 ARG H H 1 7.935 . . 1 . . . . 251 ARG H . 15551 1 218 . 1 1 103 103 ARG N N 15 119.149 . . 1 . . . . 251 ARG N . 15551 1 219 . 1 1 104 104 GLN H H 1 7.956 . . 1 . . . . 252 GLN H . 15551 1 220 . 1 1 104 104 GLN NE2 N 15 111.331 . . 2 . . . . 252 GLN HE21 . 15551 1 221 . 1 1 104 104 GLN N N 15 119.746 . . 1 . . . . 252 GLN N . 15551 1 222 . 1 1 105 105 LYS H H 1 8.114 . . 1 . . . . 253 LYS H . 15551 1 223 . 1 1 105 105 LYS N N 15 120.42 . . 1 . . . . 253 LYS N . 15551 1 224 . 1 1 106 106 ALA H H 1 8.07 . . 1 . . . . 254 ALA H . 15551 1 225 . 1 1 106 106 ALA N N 15 123.897 . . 1 . . . . 254 ALA N . 15551 1 226 . 1 1 107 107 GLN H H 1 8.165 . . 1 . . . . 255 GLN H . 15551 1 227 . 1 1 107 107 GLN HE21 H 1 7.575 . . 2 . . . . 255 GLN HE21 . 15551 1 228 . 1 1 107 107 GLN HE22 H 1 6.867 . . 2 . . . . 255 GLN HE22 . 15551 1 229 . 1 1 107 107 GLN N N 15 118.96 . . 1 . . . . 255 GLN N . 15551 1 230 . 1 1 107 107 GLN NE2 N 15 112.597 . . 1 . . . . 255 GLN NE2 . 15551 1 231 . 1 1 108 108 GLY H H 1 7.972 . . 1 . . . . 256 GLY H . 15551 1 232 . 1 1 108 108 GLY N N 15 116.028 . . 1 . . . . 256 GLY N . 15551 1 stop_ save_